| BOUCHAL, Tomáš, Ivo DURNÍK, Viktor ILLÍK a Petr KULHÁNEK. Influence of non-Watson-Crick base pairing on structure of DNA. In Modeling Interactions in Biomolecules VIII, Plzeň, Czech Republic, 3-8 September 2017. 2017. |
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@proceedings{1409516,
author = {Bouchal, Tomáš and Durník, Ivo and Illík, Viktor and Kulhánek, Petr},
booktitle = {Modeling Interactions in Biomolecules VIII, Plzeň, Czech Republic, 3-8 September 2017},
language = {eng},
title = {Influence of non-Watson-Crick base pairing on structure of DNA},
year = {2017}
}
TY - CONF
ID - 1409516
AU - Bouchal, Tomáš - Durník, Ivo - Illík, Viktor - Kulhánek, Petr
PY - 2017
TI - Influence of non-Watson-Crick base pairing on structure of DNA
N2 - This study is focused on structural properties DNA. Studied structure is 13 base pairs long palindromic DNA with all combination of base pairs in the middle of structure. We have analyzed free energy surfaces created using ABF molecular dynamics with chosen collective variable. We extracted structures around locals minima of these free energy surfaces to run QM/MM structure optimizations followed by AIM analyses of central base pairs of the DNA structures.
ER -
BOUCHAL, Tomáš, Ivo DURNÍK, Viktor ILLÍK a Petr KULHÁNEK. Influence of non-Watson-Crick base pairing on structure of DNA. In \textit{Modeling Interactions in Biomolecules VIII, Plzeň, Czech Republic, 3-8 September 2017}. 2017.
|
